%chk=000159640.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159640

0 1
 O   -3.640300      0.2146000      0.2052000    
 O    1.456600      -3.340500      0.6933000    
 O   -5.798900      0.1841000     -0.7661000    
 O   -4.438700       2.315900       1.832100    
 O    5.200000       1.296000       1.108500    
 O    4.495700     -0.6726000      0.2170000    
 N  -0.4175000      0.8336000     -0.6503000    
 N    1.759400     -0.6506000      0.1518000    
 C  -0.5508000     -0.4752000     -0.3833000    
 C   -1.790400      -1.099000     -0.5080000    
 C   0.5548000      -1.228900      2.3800001E-02
 C   -2.991600     -0.3182000     -0.9409000    
 C    1.892700      0.6583000     -0.1150000    
 C   0.7871000       1.411900     -0.5226000    
 C   0.3902000      -2.585800      0.2944000    
 C   -1.948700      -2.456500     -0.2356000    
 C  -0.8524000      -3.204100      0.1676000    
 C    3.132100       1.282400      1.0500000E-02
 C   0.9519000       2.768800     -0.7937000    
 C   -4.803000      0.9772000     -0.1299000    
 C    3.290300       2.639900     -0.2620000    
 C    2.194300       3.387100     -0.6664000    
 C   -5.398400       1.505200       1.168400    
 C    4.305800      0.5263000      0.4329000    
 C    2.219800      -3.970000     -0.3316000    
 H   -2.715800      0.4895000      -1.629700    
 H   -3.675200     -0.9779000      -1.489800    
 H   -2.918000      -2.937800     -0.3313000    
 H  -0.9682000      -4.262400      0.3830000    
 H   9.9100001E-02   3.365100      -1.112300    
 H   -4.516900       1.813800     -0.7791000    
 H    4.253200       3.136700     -0.1828000    
 H    2.302100       4.444900     -0.8857000    
 H   -6.306500       2.089300      0.9872000    
 H   -5.661000      0.6805000       1.839700    
 H    1.600200      -4.676800     -0.8926000    
 H    3.038000      -4.521300      0.1399000    
 H    2.647100      -3.224900      -1.010100    
 H   -5.643400      0.2383000      -1.724300    
 H   -4.222000       3.056700       1.240600    
 H    5.986800      0.7816000       1.388700    


%chk=000159640-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159640

0 1
O -3.948277 -0.121547 0.071489
O 1.302795 -3.827545 0.057134
O -5.804867 1.068814 0.896271
O -2.840883 2.465840 -0.808526
O 4.995320 1.362957 1.099345
O 4.367470 -0.653940 0.152104
N -0.864844 0.614381 -0.555271
N 1.488361 -0.868742 0.042131
C -0.909695 -0.755230 -0.555300
C -2.134810 -1.436449 -0.869524
C 0.315939 -1.507469 -0.228496
C -3.392330 -0.671854 -1.197124
C 1.528132 0.494627 -0.005549
C 0.315265 1.255799 -0.290690
C 0.260119 -2.964563 -0.214764
C -2.117660 -2.835417 -0.853728
C -0.954430 -3.589873 -0.536516
C 2.757894 1.219730 0.257005
C 0.338371 2.692836 -0.285187
C -4.764588 1.104012 -0.099524
C 2.730622 2.620890 0.266297
C 1.529441 3.353451 -0.003010
C -3.915281 2.355087 0.167836
C 4.054947 0.514982 0.472699
C 2.631709 -3.401538 0.558656
H -3.184377 0.155958 -1.900727
H -4.139375 -1.353096 -1.652790
H -3.041135 -3.377800 -1.087516
H -0.982029 -4.682982 -0.533589
H -0.596112 3.225107 -0.498893
H -5.175002 1.114955 -1.135598
H 3.658592 3.159107 0.475837
H 1.559604 4.447507 0.008990
H -4.540560 3.258398 0.065452
H -3.539334 2.292184 1.209951
H 3.135111 -2.719084 -0.139515
H 3.175933 -4.351940 0.671376
H 2.530093 -2.889339 1.529953
H -6.209369 0.164010 0.896853
H -2.174507 1.696575 -0.690057
H 5.853247 0.866402 1.184015


